# generated using pymatgen
data_Li(BH)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.61987700
_cell_length_b   5.61987700
_cell_length_c   6.68281846
_cell_angle_alpha   114.86438999
_cell_angle_beta   114.86438999
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li(BH)4
_chemical_formula_sum   'Li2 B8 H8'
_cell_volume   169.69387910
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Li  Li0  1  0.25000000  0.75000000  0.50000000  1
  Li  Li1  1  0.75000000  0.25000000  0.50000000  1
  B  B2  1  0.22333800  0.22333800  0.24482400  1
  B  B3  1  0.02148600  0.02148600  0.24482400  1
  B  B4  1  0.97851400  0.77666200  0.75517600  1
  B  B5  1  0.77666200  0.97851400  0.75517600  1
  B  B6  1  0.81029300  0.81029300  0.93947600  1
  B  B7  1  0.12918300  0.12918300  0.93947600  1
  B  B8  1  0.87081700  0.18970700  0.06052400  1
  B  B9  1  0.18970700  0.87081700  0.06052400  1
  H  H10  1  0.40815900  0.40815900  0.41681600  1
  H  H11  1  0.00865700  0.00865700  0.41681600  1
  H  H12  1  0.99134300  0.59184100  0.58318400  1
  H  H13  1  0.59184100  0.99134300  0.58318400  1
  H  H14  1  0.63677600  0.63677600  0.88594300  1
  H  H15  1  0.24916700  0.24916700  0.88594300  1
  H  H16  1  0.75083300  0.36322400  0.11405700  1
  H  H17  1  0.36322400  0.75083300  0.11405700  1
